methyl 5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-cyano-2-methyl-6-sulfanyl-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-mercapto-2-methyl-4-(3-thiophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-mercapto-2-methyl-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C13H12N2O2S2 MolecularWeight: 292.37658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)S)C#N)C2=CSC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)S)C#N)C2=CSC=C2)C(=O)OC

InChI

InChI=1S/C13H12N2O2S2/c1-7-10(13(16)17-2)11(8-3-4-19-6-8)9(5-14)12(18)15-7/h3-4,6,11,15,18H,1-2H3